An experimental and DFT computational study on 4-(3-(1H-imidazol-1-yl)propyl)-5-methyl-2H-1,2,4-triazol-3(4H)-one monohydrate-Reference-Cited by-同舟云学术

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An experimental and DFT computational study on 4-(3-(1H-imidazol-1-yl)propyl)-5-methyl-2H-1,2,4-triazol-3(4H)-one monohydrate

Published:2010-01-20 Issue:2 Volume:108 Page:127-139
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Tanak Hasan¹,Köysal Yavuz²,Ünver Yasemin³,Yavuz Metin¹,Işık Şamil¹,Sancak Kemal³

Affiliation:

1. a Department of Physics, Faculty of Arts and Sciences , Ondokuz Mayıs University , 55139 Kurupelit, Samsun, Turkey

2. b Samsun Vocational School, Ondokuz Mayıs University , 55139 Kurupelit, Samsun, Turkey

3. c Department of Chemistry, Faculty of Arts and Sciences , Karadeniz Technical University , 61080 Trabzon, Turkey

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268970903535491

Reference76 articles.

1. Hydrolysis Theory for Cisplatin and Its Analogues Based on Density Functional Studies

2. Conceptual and Computational DFT in the Study of Aromaticity

3. Chemical applications of density functional theory: comparison to experiment, Hartree-Fock, and perturbation theory

4. Density functional theory as a practical tool for the study of elementary reaction steps in organometallic chemistry

5. Density functional Gaussian‐type‐orbital approach to molecular geometries, vibrations, and reaction energies

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